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3-methyl-2-[(1-nitrocyclododecyl)methyl]benzo[f]benzimidazole-4,9-dione
3-methyl-2-[(1-nitrocyclododecyl)methyl]benzo[f]benzimidazole-4,9-dione
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Descriptors Computed from Structure
Canonical SMILES:
CN1C(=NC2=C1C(=O)C3=CC=CC=C3C2=O)CC4(CCCCCCCCCCC4)[N+](=O)[O-]
Isomeric SMILES
CN1C(=NC2=C1C(=O)C3=CC=CC=C3C2=O)CC4(CCCCCCCCCCC4)[N+](=O)[O-]
InChI
InChI=1S/C25H31N3O4/c1-27-20(26-21-22(27)24(30)19-14-10-9-13-18(19)23(21)29)17-25(28(31)32)15-11-7-5-3-2-4-6-8-12-16-25/h9-10,13-14H,2-8,11-12,15-17H2,1H3
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